6-[[5-chloranyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]sulfanyl]-3-methoxy-2-methyl-phenol

Systemtic Name: 6-[[5-chloranyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]sulfanyl]-3-methoxy-2-methyl-phenol Openeye Name: 6-(1-benzyl-5-chloro-triazol-4-yl)sulfanyl-3-methoxy-2-methyl-phenol CAS Name: 6-[[5-chloro-1-(phenylmethyl)-4-triazolyl]thio]-3-methoxy-2-methylphenol IUPAC Name: 6-(1-benzyl-5-chlorotriazol-4-yl)sulfanyl-3-methoxy-2-methylphenol Traditional Name: 6-[(1-benzyl-5-chloro-triazol-4-yl)thio]-3-methoxy-2-methyl-phenol Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)SC2=C(N(N=N2)CC3=CC=CC=C3)Cl)OC

Isomeric SMILES

CC1=C(C=CC(=C1O)SC2=C(N(N=N2)CC3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C17H16ClN3O2S/c1-11-13(23-2)8-9-14(15(11)22)24-17-16(18)21(20-19-17)10-12-6-4-3-5-7-12/h3-9,22H,10H2,1-2H3